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DocumentationIdentifier: MM387932
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM387932 |
| SMILES |
COC(C(C)O)C(N)CO
|
| InChIKey |
UKMVJNKIFNXINK-UHFFFAOYSA-N
|
| MW [Da] |
149.19
Automatically obtained from RDkit software. |
| LogP |
-1.3
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM180958
Similarity: 0.7516
Similarity to MM180958
| Tanimoto metric | 0.7516 |
|---|---|
| Cosine metric | 0.867 |
| Dice metric | 0.8582 |
| MW: | 133.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM387938
Similarity: 0.7514
Similarity to MM387938
| Tanimoto metric | 0.7514 |
|---|---|
| Cosine metric | 0.8581 |
| Dice metric | 0.8581 |
| MW: | 149.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM61917
Similarity: 0.7159
Similarity to MM61917
| Tanimoto metric | 0.7159 |
|---|---|
| Cosine metric | 0.8345 |
| Dice metric | 0.8344 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+176 more
